SCHEMBL28487266

SCHEMBL28487266

c1cc(OCC2CO2)cc(-c2cccc3c2Cc2ccccc2-3)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
TP53 P04637 3/20 0.56
TSHR P16473 3/20 0.56
HIF1A Q16665 2/20 0.56
CYP3A4 P08684 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
TDP1 Q9NUW8 1/20 0.50
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
FGFR1 P11362 1/20 0.38
SRC P12931 1/20 0.38
PNMT P11086 1/20 0.38
GLA P06280 1/20 0.38
MAPT P10636 2/20 0.36
HPGD P15428 2/20 0.36
CYP1A2 P05177 1/20 0.36
PPARG P37231 1/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
PKM P14618 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28034449 0.89 ALDH1A1 (0.49) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL9893603 0.87 TDP1 (0.53) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL28025821 0.84 ALDH1A1 (0.43) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL27940825 0.83 ALDH1A1 (0.40) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL23174640 0.82 ALDH1A1 (0.49) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL27922228 0.82 ALDH1A1 (0.50) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL27729373 0.82 PNMT (0.41) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL21551913 0.81 ALDH1A1 (0.43) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL28212472 0.81 ALDH1A1 (0.43) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL21553862 0.81 ALDH1A1 (0.40) ALDH1A1TP53TSHRHIF1ACYP3A4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112888579-B Rubber-like composition and method for producing same 大阪瓦斯株式会社 2024-07-09 CN disclosed
CN-107429033-B Resin composition and optical lens 大阪燃气化学有限公司 2020-11-24 CN disclosed